Products 313350-52-6

CAS 313350-52-6 is the registry number for 28-Nor Brassinolide-d3. Offered by: TRC. Available pack sizes: 25mg.

Structural formula: {0} (CAS {1})

(1S,2R,4R,5S,7S,11S,12S,15R,16S)-4,5-dihydroxy-2,16-dimethyl-15-[(2S,3R,4R)-7,7,7-trideuterio-3,4-dihydroxy-6-methylheptan-2-yl]-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one (CAS 313350-52-6) is a chemical compound with the molecular formula C27H46O6 and a molecular weight of 469.7 g/mol. IUPAC name: (1S,2R,4R,5S,7S,11S,12S,15R,16S)-4,5-dihydroxy-2,16-dimethyl-15-[(2S,3R,4R)-7,7,7-trideuterio-3,4-dihydroxy-6-methylheptan-2-yl]-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one. InChIKey: CJNLSQRTIXIHGW-BTEZCADBSA-N.

Identity
Molecular formulaC27H46O6
Molecular weight469.7 g/mol
IUPAC name(1S,2R,4R,5S,7S,11S,12S,15R,16S)-4,5-dihydroxy-2,16-dimethyl-15-[(2S,3R,4R)-7,7,7-trideuterio-3,4-dihydroxy-6-methylheptan-2-yl]-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
InChIKeyCJNLSQRTIXIHGW-BTEZCADBSA-N
SMILES[2H]C([2H])([2H])C(C)C[C@H]([C@@H]([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2COC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)O)O

Computed by PubChem (NCBI)